DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Dipeptidyl peptidase 4
Ligand Name
5-(AMINOMETHYL)-6-(2,4-DICHLOROPHENYL)-2-(3,5-DIMETHOXYPHENYL)PYRIMIDIN-4-AMINE
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
RCJFINNFYUNFGH-UHFFFAOYSA-N
SMILES
COc1cc(cc(c1)OC)c2nc(c(c(n2)N)CN)c3ccc(cc3Cl)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 1RWQ
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse1rwqA1e1rwqA2e1rwqB1e1rwqB2
ECOD domains from experimental PDB structures interacting with ligand DB02004
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P27487DB020045AP1rwqe1rwqA1A:39-508
P27487DB020045AP1rwqe1rwqA2A:509-766
P27487DB020045AP1rwqe1rwqB1B:39-508
P27487DB020045AP1rwqe1rwqB2B:509-766